U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H14O3
Molecular Weight 158.195
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPYL LEVULINATE

SMILES

CCCOC(=O)CCC(C)=O

InChI

InChIKey=QOSMNYMQXIVWKY-UHFFFAOYSA-N
InChI=1S/C8H14O3/c1-3-6-11-8(10)5-4-7(2)9/h3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H14O3
Molecular Weight 158.195
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:44:17 GMT 2025
Edited
by admin
on Mon Mar 31 20:44:17 GMT 2025
Record UNII
V2C79957U4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4480
Preferred Name English
PROPYL LEVULINATE
Systematic Name English
LEVULINIC ACID, PROPYL ESTER
Common Name English
PENTANOIC ACID, 4-OXO-, PROPYL ESTER
Common Name English
NSC-4876
Code English
Classification Tree Code System Code
JECFA EVALUATION PROPYL LEVULINATE
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
Code System Code Type Description
JECFA MONOGRAPH
1949
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY
EPA CompTox
DTXSID70214753
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY
CAS
645-67-0
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY
NSC
4876
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY
PUBCHEM
221069
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY
FDA UNII
V2C79957U4
Created by admin on Mon Mar 31 20:44:17 GMT 2025 , Edited by admin on Mon Mar 31 20:44:17 GMT 2025
PRIMARY